Citric Acid → 3-tert-Butoxycarbonylamino-2-hydroxy-4-phenylbutyric acid

HRID 196965Notes

Reaction equation

HRID 196965 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([CH:10]([CH2:11][Cl:12])[OH:13])[CH2:14][c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1.[CH3:21][CH:22]([OH:23])[CH3:24].[Na+:26].[OH-:25].[OH2:40].[OH:27][C:28]([CH2:29][C:30]([C:31](=[O:32])[OH:33])([CH2:34][C:35](=[O:36])[OH:37])[OH:38])=[O:39]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([CH:10]([C:11](=[O:25])[OH:40])[OH:13])[CH2:14][c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1

Participants

7

Reactant 6

HCID 311Citric AcidHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 3776IsopropanolHCID 4712659(2R,3S)-3-(Tert-butoxycarbonylamino)-1-chloro-2-hydroxy-4-phenylbutane

Product 1

HCID 34203793-tert-Butoxycarbonylamino-2-hydroxy-4-phenylbutyric acid

Sources & evidence

ORD record
ord-b2760818b3b348d997c464beecbd6924
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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